N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)-2-quinoxalinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[3-(piazthiol-5-ylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C21H16N6O2S2 MolecularWeight: 448.52074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=NSN=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=NSN=C5C=C4

InChI

InChI=1S/C21H16N6O2S2/c1-13-6-9-15(10-7-13)31(28,29)27-21-20(23-16-4-2-3-5-17(16)24-21)22-14-8-11-18-19(12-14)26-30-25-18/h2-12H,1H3,(H,22,23)(H,24,27)